ChemSpider 2D Image | (2S)-2-[(2-Amino-7-fluoropyrido[3,2-d]pyrimidin-4-yl)amino]-2-methyl-1-hexanol | C14H20FN5O

(2S)-2-[(2-Amino-7-fluoropyrido[3,2-d]pyrimidin-4-yl)amino]-2-methyl-1-hexanol

  • Molecular FormulaC14H20FN5O
  • Average mass293.340 Da
  • Monoisotopic mass293.165192 Da
  • ChemSpider ID81368353

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2S)-2-[(2-Amino-7-fluoropyrido[3,2-d]pyrimidin-4-yl)amino]-2-methyl-1-hexanol [ACD/IUPAC Name]
(2S)-2-[(2-Amino-7-fluoropyrido[3,2-d]pyrimidin-4-yl)amino]-2-méthyl-1-hexanol [French] [ACD/IUPAC Name]
(2S)-2-[(2-Amino-7-fluorpyrido[3,2-d]pyrimidin-4-yl)amino]-2-methyl-1-hexanol [German] [ACD/IUPAC Name]
1-Hexanol, 2-[(2-amino-7-fluoropyrido[3,2-d]pyrimidin-4-yl)amino]-2-methyl-, (2S)- [ACD/Index Name]
2004677-13-6 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 535.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.4±3.0 kJ/mol
Flash Point: 277.4±32.9 °C
Index of Refraction: 1.642
Molar Refractivity: 81.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.72
ACD/LogD (pH 5.5): 2.65
ACD/BCF (pH 5.5): 57.11
ACD/KOC (pH 5.5): 583.29
ACD/LogD (pH 7.4): 2.77
ACD/BCF (pH 7.4): 74.45
ACD/KOC (pH 7.4): 760.32
Polar Surface Area: 97 Å2
Polarizability: 32.3±0.5 10-24cm3
Surface Tension: 63.0±3.0 dyne/cm
Molar Volume: 225.8±3.0 cm3

Click to predict properties on the Chemicalize site


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